8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine

C13H17N3O2 — CID 122652357

IUPAC8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine
SMILESCOc1nc(C)cn2c(C3CCCOC3)ncc12
InChIInChI=1S/C13H17N3O2/c1-9-7-16-11(13(15-9)17-2)6-14-12(16)10-4-3-5-18-8-10/h6-7,10H,3-5,8H2,1-2H3
InChIKeyONJBPBYBWJIUMW-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.94
Rot. Bonds2

About 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine

8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine (PubChem CID 122652357) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine
PubChem CID122652357
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine
SMILESCOc1nc(C)cn2c(C3CCCOC3)ncc12
InChIInChI=1S/C13H17N3O2/c1-9-7-16-11(13(15-9)17-2)6-14-12(16)10-4-3-5-18-8-10/h6-7,10H,3-5,8H2,1-2H3
InChIKeyONJBPBYBWJIUMW-UHFFFAOYSA-N
XLogP1.94
TPSA48.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine?
The IUPAC name of 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine (CID 122652357) is 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine is COc1nc(C)cn2c(C3CCCOC3)ncc12.
What is the InChIKey of 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine?
The InChIKey is ONJBPBYBWJIUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-9-7-16-11(13(15-9)17-2)6-14-12(16)10-4-3-5-18-8-10/h6-7,10H,3-5,8H2,1-2H3.
What are the key properties of 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine?
8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine has a molecular weight of 247.30 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-6-methyl-3-(oxan-3-yl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 122652357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).